Information card for entry 4337338

Structure parameters

• Formula: C78 H74 Co2 F24 Ho2 N4 O16
• Calculated formula: C78 H74 Co2 F24 Ho2 N4 O16
• SMILES: [Ho]12345([O]6[Co]789%10[O]%11[Ho]%12%13%14([O]([Co]%15%16%17([O]1=C%11c1ccccc1)[O]5c1c(C[N]%15(CC[N]%16(C)Cc5c(c(C)cc(c5)C)[O]%13%17)C)cc(cc1C)C)=C6c1ccccc1)([O]7c1c(cc(cc1C)C)C[N]9(CC[N]%10(C)Cc1c([O]48)c(C)cc(c1)C)C)([O]=C(C=C(O%12)C(F)(F)F)C(F)(F)F)OC(=CC(=[O]%14)C(F)(F)F)C(F)(F)F)(OC(=CC(=[O]2)C(F)(F)F)C(F)(F)F)[O]=C(C=C(O3)C(F)(F)F)C(F)(F)F
• Title of publication: Tetranuclear Hetero-Metal [Co(II)2Ln(III)2] (Ln = Gd, Tb, Dy, Ho, La) Complexes Involving Carboxylato Bridges in a Rare μ4-η(2):η(2) Mode: Synthesis, Crystal Structures, and Magnetic Properties.
• Authors of publication: Abtab, Sk Md Towsif; Majee, Mithun Chandra; Maity, Manoranjan; Titiš, Ján; Boča, Roman; Chaudhury, Muktimoy
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 3
• Pages of publication: 1295 - 1306
• a: 12.4729 ± 0.0008 Å
• b: 31.218 ± 0.002 Å
• c: 23.1884 ± 0.0015 Å
• α: 90°
• β: 100.334 ± 0.002°
• γ: 90°
• Cell volume: 8882.6 ± 1 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 7
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0613
• Residual factor for significantly intense reflections: 0.0451
• Weighted residual factors for significantly intense reflections: 0.1207
• Weighted residual factors for all reflections included in the refinement: 0.1349
• Goodness-of-fit parameter for all reflections included in the refinement: 0.905
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No